COMPOUND: C18240
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Entry
C18240 Compound
Name
Tetrachlorocatechol;
Tetrachloro-1,2-benzenediol
Formula
C6H2Cl4O2
Exact mass
245.8809
Mol weight
247.88
Structure
Mol file
KCF file
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Reaction
R09132
R09133
R09134
Pathway
map00361
Chlorocyclohexane and chlorobenzene degradation
map01120
Microbial metabolism in diverse environments
map01220
Degradation of aromatic compounds
Enzyme
1.3.1.-
1.13.11.1
Other DBs
CAS:
1198-55-6
PubChem:
103061422
ChEBI:
26889
KNApSAcK:
C00016089
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KCF data
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ATOM 12
1 C8y C 24.7840 -18.2901
2 C8y C 24.7840 -19.6858
3 C8y C 25.9927 -20.3837
4 C8y C 27.2015 -19.6858
5 C8y C 27.2015 -18.2901
6 C8y C 25.9927 -17.5922
7 X Cl 25.9927 -16.1967
8 X Cl 28.4288 -17.5813
9 X Cl 28.4288 -20.3946
10 X Cl 25.9927 -21.7792
11 O1a O 23.5599 -17.5835
12 O1a O 23.5755 -20.3835
BOND 12
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 6 7 1
8 5 8 1
9 4 9 1
10 3 10 1
11 1 11 1
12 2 12 1
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